2-(1,3-benzodioxol-5-yl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)acetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)acetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)acetamide Formula: C17H13N3O5S MolecularWeight: 371.36722

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H13N3O5S/c1-19-12-8-11(20(22)23)3-5-15(12)26-17(19)18-16(21)7-10-2-4-13-14(6-10)25-9-24-13/h2-6,8H,7,9H2,1H3